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Cyclohexanecarboxylic acid, 2-hydroxy-1,6-dimethyl-, methyl ester, [1S-(1.alpha.,2.beta.,6.alpha.)]-
SpectraBase Compound ID RSExLrbwHQ
InChI InChI=1S/C10H18O3/c1-7-5-4-6-8(11)10(7,2)9(12)13-3/h7-8,11H,4-6H2,1-3H3/t7-,8-,10-/m0/s1
InChIKey PGTLDRGEZFLQIX-NRPADANISA-N
Mol Weight 186.25 g/mol
Molecular Formula C10H18O3
Exact Mass 186.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4JOZ8wzIYTK
Name Cyclohexanecarboxylic acid, 2-hydroxy-1,6-dimethyl-, methyl ester, [1S-(1.alpha.,2.beta.,6.alpha.)]-
Alternate Name(s) Methyl (1S,2S,6S)-2-hydroxy-1,6-dimethylcyclohexanecarboxylate
CAS Registry Number 121842-99-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O3
InChI InChI=1S/C10H18O3/c1-7-5-4-6-8(11)10(7,2)9(12)13-3/h7-8,11H,4-6H2,1-3H3/t7-,8-,10-/m0/s1
InChIKey PGTLDRGEZFLQIX-NRPADANISA-N
Molecular Weight 186.251 g/mol
SMILES O[C@@]1([C@@](C(=O)OC)([C@](CCC1)(C)[H])C)[H]
SPLASH splash10-066r-4900000000-bce2d07afd6f43ea9594
Source of Spectrum H-72-711-22
Wiley ID 1182825